2-butyl-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-heptanoic acid

Systemtic Name: 2-butyl-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-heptanoic acid Openeye Name: 2-butyl-2-hydroxy-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 2-butyl-2-hydroxy-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 2-butyl-2-hydroxy-7-[(1R,2R)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 2-butyl-2-hydroxy-7-[(1R,5R)-2-keto-5-[(E)-oct-1-enyl]cyclopentyl]enanthic acid Formula: C24H42O4 MolecularWeight: 394.58788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1CCC(=O)C1CCCCCC(CCCC)(C(=O)O)O

Isomeric SMILES

CCCCCC/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCC(CCCC)(C(=O)O)O

InChI

InChI=1S/C24H42O4/c1-3-5-7-8-9-11-14-20-16-17-22(25)21(20)15-12-10-13-19-24(28,23(26)27)18-6-4-2/h11,14,20-21,28H,3-10,12-13,15-19H2,1-2H3,(H,26,27)/b14-11+/t20-,21+,24?/m0/s1